Geometry & MOs

Info

ID:	44216
PubChem CID:	10502041
Reduced:	O3C12H16 (2)
Stoich.:	A3B12C16 (2)
Weight, g/mol:	416.17763
ΔH_f, kcal/mol:	-212.1
Dipole, Da:	1.51
IP(EA), eV:	-8.64(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,7,22,25-tetramethylhexacyclo[16.8.0.02,11.03,8.012,17.021,26]hexacosa-1(18),2(11),3,5,7,9,12(17),14,21,23,25-undecaene-13,16-dione

Drug info:

PubChemData

Smile

CC(C)(C)CC1(COC2=CC=CC=C2OCCOCCOC3=CC=CC=C3OC1)O

DOS

IR

Vibrations